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(Q105210804)
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Aminobenzoate C
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
biogenic alkylphenol
0 references
mass
321.157622836
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₇H₂₃NO₅
0 references
canonical SMILES
CCC(Cc1ccc(NC(C)=O)c(O)c1)C(O)CC=CC(=O)O
0 references
isomeric SMILES
CC[C@@H](Cc1ccc(NC(C)=O)c(O)c1)[C@@H](O)C/C=C/C(=O)O
0 references
found in taxon
Streptomyces
1 reference
stated in
Isolation and Identification of Secondary Metabolites FromStreptomycessp. SP301
Identifiers
InChI
InChI=1S/C17H23NO5/c1-3-13(15(20)5-4-6-17(22)23)9-12-7-8-14(16(21)10-12)18-11(2)19/h4,6-8,10,13,15,20-21H,3,5,9H2,1-2H3,(H,18,19)(H,22,23)/b6-4+/t13-,15-/m0/s1
0 references
InChIKey
PLAXVPYBGNWOPG-VZFYUFDISA-N
0 references
PubChem CID
146683522
2 references
stated in
PubChem
retrieved
26 December 2021
inferred from
InChIKey
matched by identifier from
InChIKey
InChIKey
PLAXVPYBGNWOPG-VZFYUFDISA-N
ChEBI ID
211790
mapping relation type
exact match
1 reference
matched by identifier from
International Chemical Identifier
InChI
InChI=1S/C17H23NO5/c1-3-13(15(20)5-4-6-17(22)23)9-12-7-8-14(16(21)10-12)18-11(2)19/h4,6-8,10,13,15,20-21H,3,5,9H2,1-2H3,(H,18,19)(H,22,23)/b6-4+/t13-,15-/m0/s1
UniChem compound ID
178086885
1 reference
stated in
UniChem
Natural Product Atlas ID
NPA027122
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
PLAXVPYBGNWOPG-VZFYUFDISA-N
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